General Information of the Compound
| Compound ID |
CP0457142
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-phenyl-6-(3-pyrrolidin-1-ylpropoxy)-1,3-benzoxazole
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H22N2O2
|
||||||||||||||||||
| Molecular Weight |
322.408
|
||||||||||||||||||
| Canonical SMILES |
C(COc1ccc2nc(oc2c1)-c1ccccc1)CN1CCCC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H22N2O2/c1-2-7-16(8-3-1)20-21-18-10-9-17(15-19(18)24-20)23-14-6-13-22-11-4-5-12-22/h1-3,7-10,15H,4-6,11-14H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
CEMLVWCAMWKAPN-UHFFFAOYSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound